chempirical

Lovastatin

C24H36O5CAS 75330-75-5404.55 g/mol

Open in Covalent MOL file
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AlcoholAlkeneEsterLactone

Properties

Molecular formula
C24H36O5
Molar mass
404.55 g/mol
Exact mass
404.2563 Da
Melting point
174 °C
logP
4.20Crippen estimate
Polar surface area
72.8 Ų
H-bond donors / acceptors
1 / 5
Rotatable bonds
6
Stereocentres
S, S, R, S, S, R, R, Rin SMILES atom order

Identifiers

CAS number
75330-75-5
SMILES
CC[C@H](C)C(=O)O[C@H]1C[C@@H](C)C=C2C=C[C@H](C)[C@H](CC[C@@H]3C[C@@H](O)CC(=O)O3)[C@H]21
InChIKey
PCZOHLXUXFIOCF-BXMDZJJMSA-N
InChI
InChI=1S/C24H36O5/c1-5-15(3)24(27)29-21-11-14(2)10-17-7-6-16(4)20(23(17)21)9-8-19-12-18(25)13-22(26)28-19/h6-7,10,14-16,18-21,23,25H,5,8-9,11-13H2,1-4H3/t14-,15-,16-,18+,19+,20-,21-,23-/m0/s1

Weigh it out

Type any one amount. The others follow from the molar mass.

Names and synonyms

24 names · show all
  • Butanoic acid, 2-methyl-, (1S,3R,7S,8S,8aR)-1,2,3,7,8,8a-hexahydro-3,7-dimethyl-8-[2-[(2R,4R)-tetrahydro-4-hydroxy-6-oxo-2H-pyran-2-yl]ethyl]-1-naphthalenyl ester, (2S)-
  • Butanoic acid, 2-methyl-, 1,2,3,7,8,8a-hexahydro-3,7-dimethyl-8-[2-(tetrahydro-4-hydroxy-6-oxo-2H-pyran-2-yl)ethyl]-1-naphthalenyl ester, [1S-[1α(R*),3α,7β,8β(2S*,4S*),8aβ]]-
  • Mevinolin
  • MSD 803
  • Monacolin K
  • Antibiotic MB 530B
  • MK 803
  • Monacolin K lactone
  • Mevacor
  • L 154803
  • (+)-Mevinolin
  • 6α-Methylcompactin
  • Sivlor
  • Mevlor
  • Lovalip
  • Mevinacor
  • Altocor
  • Lovastatin lactone
  • Lostatin
  • Lestric
  • Lovacard
  • Lovex
  • Altoprev
  • NSC 633781

Work with Lovastatin

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

Mevastatin73573-88-378 % similar Lovastatin sodium salt75225-50-270 % similar Simvastatin79902-63-969 % similar Pravastatin81093-37-062 % similar Pravastatin sodium81131-70-659 % similar Simvastatin ammonium salt139893-43-949 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Elsewhere

PubChem CAS Common Chemistry NIST WebBook